Geometry & MOs

Info

ID:	251967
PubChem CID:	103108154
Reduced:	BrN2O2C11H21 (1)
Stoich.:	AB2C2D11E21 (1)
Weight, g/mol:	282.113506
ΔH_f, kcal/mol:	-124.8
Dipole, Da:	2.88
IP(EA), eV:	-9.61(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C(C(C)C)Br

DOS

IR

Vibrations